Vitas-M small molecule compound
5-ethyl-3,3-dimethyl-6-(3-nitrophenyl)dihydro-2H-pyran-2,4(3H)-dione
Catalog ID
STK838643
SMILES CCC1C(OC(=O)C(C1=O)(C)C)c1cccc(c1)[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C15H17NO5 MW 291.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17NO5/c1-4-11-12(21-14(18)15(2,3)13(11)17)9-6-5-7-10(8-9)16(19)20/h5-8,11-12H,4H2,1-3H3InChIKey
UNBFTTTWTUDHES-UHFFFAOYSA-NSynonyms
381198-78-3381198783
5ethyl33dimethyl6(3nitrophenyl)dihydro2Hpyran24(3H)dione
5ETHYL33DIMETHYL6(3NITROPHENYL)OXANE24DIONE
CCC1C(OC(=O)C(C1=O)(C)C)c1cccc(c1)(N+)(=O)(O)
CCC1C(OC(=O)C(C1=O)(C)C)C2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC15H17NO5c141112(2114(18)15(23)13(11)17)965710(89)16(19)20h581112H4H213H3
MFCD02637286
ZINC000000193107
ZINC000000193116
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